dihydroisopentenyldehydrorhodopin

Chemical Formula:

C₄₅H₆₆O

Molecular Weight:

623.016 Daltons

Monoisotopic Mass:

622.5113667407 Daltons

SMILES:

CC(C)=CCCC(=CC=CC(=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC(C(C)(C)O)CC=C(C)C)C)C

InChI:

1S/C45H66O/c1-36(2)20-15-23-40(7)26-18-29-41(8)27-16-24-38(5)21-13-14-22-39(6)25-17-28-42(9)30-19-31-43(10)33-35-44(45(11,12)46)34-32-37(3)4/h13-14,16-22,24-32,44,46H,15,23,33-35H2,1-12H3/b14-13+,24-16+,25-17+,29-18+,30-19+,38-21+,39-22+,40-26+,41-27+,42-28+,43-31+/t44-/m0/s1

InChIKey:

DBNMXBPBTSCRMV-DHRLHYKWSA-N

Synonyms

C.p.482

Databases

MetaCyc: CPD-18005

PubChem (CID): 129900393

ChEBI: 87163

MetaNetX: MNXM149031

KEGG: C22058